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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
432948 |
135173085 |
1 |
OSN2C8H10 |
ABC2D8E10 |
20.41 |
2.14 |
-9.41 |
-0.39 |
0 |
|
|
432949 |
135173086 |
1 |
NOSC9H11 |
ABCD9E11 |
10.94 |
4.05 |
-8.8 |
-0.57 |
0 |
|
|
432950 |
135173087 |
1 |
OSN2C8H10 |
ABC2D8E10 |
21.43 |
3.05 |
-9.15 |
-0.44 |
0 |
|
|
432951 |
135173088 |
1 |
ClNOH18C24 |
ABCD18E24 |
57.31 |
1.81 |
-9.36 |
-0.36 |
0 |
|
|
432952 |
135173089 |
1 |
ClNH16C24 |
ABC16D24 |
105.92 |
1.95 |
-8.91 |
-0.68 |
0 |
|
|
432953 |
135173090 |
1 |
NH25C36 |
AB25C36 |
161.28 |
2.94 |
-8.91 |
-0.56 |
0 |
|
|
432954 |
135173091 |
1 |
ON10C27H32 |
AB10C27D32 |
133.94 |
3.77 |
-8.04 |
-2.3 |
0 |
|
|
432955 |
135173092 |
1 |
ON5C23H27 |
AB5C23D27 |
62.88 |
7.33 |
-8.5 |
-0.3 |
0 |
|
|
432956 |
135173093 |
1 |
ClNOH18C24 |
ABCD18E24 |
56.4 |
1.24 |
-9.38 |
-0.33 |
0 |
|
|
432957 |
135173094 |
1 |
ClNOH18C24 |
ABCD18E24 |
58.98 |
1.48 |
-9.3 |
-0.21 |
0 |
|
|
432958 |
135173095 |
1 |
ClNH16C24 |
ABC16D24 |
107.4 |
3.56 |
-8.83 |
-0.5 |
0 |
|
|
432959 |
135173096 |
1 |
ClNH18C24 |
ABC18D24 |
161.14 |
2.75 |
-8.19 |
-1.01 |
0 |
|
|
432960 |
135173097 |
4 |
NH9C14 |
AB9C14 |
283.77 |
3.11 |
-8.45 |
-1.07 |
0 |
|
|
432961 |
135173098 |
1 |
FO2N9C32H34 |
AB2C9D32E34 |
64.13 |
4.65 |
-8.82 |
-2.41 |
0 |
|
|
432962 |
135173099 |
1 |
ClNH16C24 |
ABC16D24 |
107.67 |
2.56 |
-9.18 |
-0.82 |
0 |
|
|
432963 |
135173100 |
1 |
ClNOH18C24 |
ABCD18E24 |
57.54 |
2.32 |
-9.53 |
-0.37 |
0 |
|
|
432964 |
135173101 |
2 |
NH16C24 |
AB16C24 |
220.18 |
4.3 |
-8.2 |
-0.55 |
0 |
|
|
432965 |
135173102 |
1 |
N3H33C46 |
A3B33C46 |
226.82 |
1.07 |
-8.54 |
-0.87 |
0 |
|
|
432966 |
135173103 |
1 |
N3H41C48 |
A3B41C48 |
244.52 |
0.73 |
-8.31 |
-0.66 |
0 |
|
|
432968 |
135173105 |
1 |
N4C5H10 |
A4B5C10 |
60.1 |
2.14 |
-8.56 |
0.46 |
0 |
|
|
432969 |
135173106 |
1 |
N3C4H11 |
A3B4C11 |
55.98 |
3.37 |
-9.14 |
1.49 |
0 |
|
|
432970 |
135173107 |
1 |
N5H39C55 |
A5B39C55 |
292.13 |
2.9 |
-8.44 |
-0.93 |
0 |
|
|
432971 |
135173108 |
1 |
O2C17H18 |
A2B17C18 |
-31.77 |
2.9 |
-9.05 |
-0.16 |
0 |
|
|
432972 |
135173109 |
1 |
N4H30C45 |
A4B30C45 |
247.61 |
2.47 |
-8.99 |
-1.18 |
0 |
|
|
432973 |
135173110 |
1 |
SO4N5C12H13 |
AB4C5D12E13 |
-65.18 |
6.85 |
-9.06 |
-1.4 |
0 |
|
|
432974 |
135173111 |
1 |
SN4O8H26C34 |
AB4C8D26E34 |
-141.85 |
6.57 |
-9.36 |
-2.46 |
0 |
|
|
432975 |
135173112 |
1 |
SF2O2N9H21C25 |
AB2C2D9E21F25 |
44.94 |
9.2 |
-8.31 |
-1.69 |
0 |
|
|
432976 |
135173113 |
5 |
NH7C11 |
AB7C11 |
299.82 |
1.53 |
-8.43 |
-1.2 |
0 |
|
|
432977 |
135173114 |
1 |
NCl2O6C53H85 |
AB2C6D53E85 |
-405.61 |
4.05 |
-8.42 |
-0.37 |
0 |
|
|
432978 |
135173115 |
1 |
F2O2H12C15 |
A2B2C12D15 |
-130.58 |
4.84 |
-9.21 |
-0.5 |
0 |
|
|
432979 |
135173116 |
1 |
N2F3O3H13C18 |
A2B3C3D13E18 |
-151.02 |
5.19 |
-9.71 |
-1.38 |
0 |
|
|
432980 |
135173117 |
1 |
F3N3O4H12C16 |
A3B3C4D12E16 |
-178.07 |
5.75 |
-9.61 |
-1.65 |
0 |
|
|
432981 |
135173118 |
1 |
ClNH16C24 |
ABC16D24 |
106.23 |
1.37 |
-9.05 |
-0.74 |
0 |
|
|
432982 |
135173119 |
1 |
O2C15H22 |
A2B15C22 |
-104.88 |
1.96 |
-9.57 |
0.14 |
0 |
|
|
432983 |
135173120 |
2 |
N2H18C27 |
A2B18C27 |
274.37 |
4.48 |
-8.21 |
-1.2 |
0 |
|
|
432984 |
135173121 |
1 |
BrN3H20C30 |
AB3C20D30 |
156.51 |
6.3 |
-8.16 |
-1.39 |
0 |
|
|
432985 |
135173122 |
1 |
O3N5C6H13 |
A3B5C6D13 |
-75.85 |
2.23 |
-9.83 |
-0.61 |
0 |
|
|
432986 |
135173123 |
2 |
N2H19C28 |
A2B19C28 |
282.68 |
3.31 |
-8.48 |
-1.1 |
0 |
|
|
432987 |
135173124 |
1 |
OF2N8H26C30 |
AB2C8D26E30 |
67.85 |
10.11 |
-8.84 |
-2.4 |
0 |
|
|
432988 |
135173125 |
1 |
ClN2H17C22 |
AB2C17D22 |
104.13 |
1.92 |
-9.22 |
-0.85 |
0 |
|
|
432989 |
135173126 |
1 |
N3H31C46 |
A3B31C46 |
232.6 |
3.98 |
-9.02 |
-0.95 |
0 |
|
|
432990 |
135173127 |
1 |
ClNH16C24 |
ABC16D24 |
105.79 |
3.27 |
-9.04 |
-0.69 |
0 |
|
|
432991 |
135173128 |
1 |
SO4N5C12H13 |
AB4C5D12E13 |
-69.63 |
8.75 |
-9.13 |
-1.41 |
0 |
|
|
432992 |
135173129 |
1 |
O2C9H12 |
A2B9C12 |
-40.17 |
1.4 |
-8.16 |
0.27 |
0 |
|
|
432993 |
135173130 |
1 |
FON9H20C25 |
ABC9D20E25 |
137.44 |
9.83 |
-8.98 |
-2.5 |
0 |
|
|
432994 |
135173131 |
1 |
ClNOH18C24 |
ABCD18E24 |
56.58 |
2.68 |
-9.35 |
-0.31 |
0 |
|
|
432995 |
135173132 |
1 |
SO4N6C12H14 |
AB4C6D12E14 |
-86.27 |
7.7 |
-9.58 |
-1.14 |
0 |
|
|
432996 |
135173133 |
1 |
BrNH16C18 |
ABC16D18 |
70.74 |
4.29 |
-8.23 |
-0.46 |
0 |
|
|
432997 |
135173134 |
1 |
NH37C55 |
AB37C55 |
245.67 |
2.01 |
-8.56 |
-0.71 |
0 |
|
|
432998 |
135173135 |
1 |
FON9H22C27 |
ABC9D22E27 |
149.77 |
10.93 |
-8.81 |
-2.43 |
0 |
|
|
432999 |
135173136 |
2 |
NH14C21 |
AB14C21 |
197.7 |
2.72 |
-8.13 |
-0.46 |
0 |
|
|
433000 |
135173137 |
1 |
O3C16H18 |
A3B16C18 |
-72.11 |
2.93 |
-8.23 |
0.18 |
0 |
|
|
433001 |
135173138 |
1 |
NSO2C8H11 |
ABC2D8E11 |
-61.06 |
4.04 |
-8.01 |
-0.07 |
0 |
|
|
433002 |
135173139 |
1 |
NOPH28C36 |
ABCD28E36 |
157.21 |
4.78 |
-8.11 |
-0.62 |
0 |
|
|
433003 |
135173140 |
1 |
N4H30C39 |
A4B30C39 |
210.72 |
2.23 |
-7.98 |
-1.19 |
0 |
|
|
433004 |
135173141 |
1 |
FO2N9H30C31 |
AB2C9D30E31 |
104.02 |
8.77 |
-8.83 |
-2.35 |
0 |
|
|
433005 |
135173142 |
1 |
NH29C42 |
AB29C42 |
184.26 |
2.98 |
-8.91 |
-0.57 |
0 |
|
|
433006 |
135173143 |
1 |
N4H26C39 |
A4B26C39 |
222.74 |
2.25 |
-8.96 |
-1.14 |
0 |
|
|
433007 |
135173144 |
2 |
NC5H9 |
AB5C9 |
-12.36 |
2.67 |
-9.18 |
1.28 |
0 |
|
|
433008 |
135173145 |
1 |
NOH23C36 |
ABC23D36 |
136.67 |
3.27 |
-8.93 |
-0.72 |
0 |
|
|
433009 |
135173146 |
1 |
FO2N9C35H36 |
AB2C9D35E36 |
64.25 |
1.11 |
-8.71 |
-2.39 |
0 |
|
|
433010 |
135173147 |
1 |
SO3N6C19H22 |
AB3C6D19E22 |
-30.47 |
4.89 |
-8.62 |
-0.62 |
0 |
|
|
433011 |
135173148 |
2 |
OC9H14 |
AB9C14 |
-124.98 |
2.27 |
-9.2 |
0.31 |
0 |
|
|
433012 |
135173149 |
1 |
FON10H25C26 |
ABC10D25E26 |
123.14 |
7.44 |
-8.61 |
-2.61 |
0 |
|
|
433013 |
135173150 |
1 |
O4C27H40 |
A4B27C40 |
-166.38 |
3.67 |
-8.47 |
0.22 |
0 |
|
|
433014 |
135173151 |
1 |
OSN2C9H16 |
ABC2D9E16 |
-3.75 |
5.42 |
-8.91 |
0.11 |
0 |
|
|
433015 |
135173152 |
1 |
N3O5C30H57 |
A3B5C30D57 |
-215.87 |
4.93 |
-8.83 |
0.7 |
0 |
|
|
433016 |
135173153 |
1 |
N5O5C33H65 |
A5B5C33D65 |
-220.55 |
5.9 |
-9.04 |
1.34 |
0 |
|
|
433017 |
135173154 |
1 |
SO3N5C20H23 |
AB3C5D20E23 |
-40.56 |
6.58 |
-8.87 |
-0.79 |
0 |
|
|
433018 |
135173155 |
1 |
NPO4C8H12 |
ABC4D8E12 |
-195.64 |
3.56 |
-9.09 |
-0.33 |
0 |
|
|
433019 |
135173156 |
2 |
O2H6C7 |
A2B6C7 |
-125.97 |
2.99 |
-9.02 |
-0.85 |
0 |
|
|
433020 |
135173157 |
1 |
FO2N9C34H36 |
AB2C9D34E36 |
58.07 |
7.88 |
-8.88 |
-2.51 |
0 |
|
|
433021 |
135173158 |
1 |
NSO2C11H15 |
ABC2D11E15 |
-82.5 |
1.61 |
-8.64 |
-0.25 |
0 |
|
|
433022 |
135173159 |
1 |
O3C14H28 |
A3B14C28 |
-202.09 |
3.75 |
-10.23 |
1.62 |
0 |
|
|
433023 |
135173160 |
1 |
NC13H25 |
AB13C25 |
-17.85 |
2.51 |
-9.33 |
1.08 |
0 |